Information card for entry 7122366

Structure parameters

• Chemical name: UO2 4 tBu Ph
• Formula: C68 H68 N4 O10 U2
• Calculated formula: C68 H68 N4 O10 U2
• Title of publication: Expanded Campestarene Hosts for Tetra- and Dinuclear Uranyl(VI) Complexes
• Authors of publication: Chaudhry, Mohammad; Lelj, Francesco; MacLachlan, Mark
• Journal of publication: Chemical Communications
• Year of publication: 2018
• a: 35.7713 ± 0.0016 Å
• b: 35.7713 ± 0.0016 Å
• c: 28.7439 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 36780 ± 3 ų
• Cell temperature: 90 K
• Ambient diffraction temperature: 90 K
• Number of distinct elements: 5
• Space group number: 142
• Hermann-Mauguin space group symbol: I 41/a c d
• Hall space group symbol: -I 4bd 2c
• Residual factor for all reflections: 0.1035
• Residual factor for significantly intense reflections: 0.0569
• Weighted residual factors for significantly intense reflections: 0.121
• Weighted residual factors for all reflections included in the refinement: 0.1522
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No